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Home > Boronic Acids > 352359-11-6
352359-11-6 | 1-(tert-Butoxycarbonyl)-5-indolineboronic acid
CAS No: 352359-11-6 Catalog No: AG00I6ZJ MDL No:MFCD06801697
Product Description
Catalog Number:
AG00I6ZJ
Chemical Name:
1-(tert-Butoxycarbonyl)-5-indolineboronic acid
CAS Number:
352359-11-6
Molecular Formula:
C13H18BNO4
Molecular Weight:
263.0973
MDL Number:
MFCD06801697
IUPAC Name:
[1-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindol-5-yl]boronic acid
InChI:
InChI=1S/C13H18BNO4/c1-13(2,3)19-12(16)15-7-6-9-8-10(14(17)18)4-5-11(9)15/h4-5,8,17-18H,6-7H2,1-3H3
InChI Key:
QOMTYDDBSAMVBY-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1ccc(c2)B(O)O)OC(C)(C)C
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.133g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.1g/mol
Monoisotopic Mass:
263.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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